[Pw_forum] atomic positions

Abolore Musari abmus007 at gmail.com
Sat Jan 1 10:26:59 CET 2011


Dear QE User,
I need help concerning the atomic positions to compute the band structure of
materials am working on. Pls take Sio2 in the examples file as an example.
pls i need u to explain in details how the atomic positions of the elements
of sio2 are gotten so that I can apply the same method to get mine. Pls  I
really need a detailed explanation
Thanks and happy new year to all

Abolore Abdulganiy
Dept of physics
University of ibadan, Nigeria
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